%chk=000042463.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000042463

0 1
 O  -0.3009000       1.564000      1.9999999E-04
 O    3.079300      -1.124800      -1.100900    
 O    3.078600      -1.125700       1.101600    
 N    2.556500     -0.9115000      3.0000001E-04
 C    1.083200       1.121000     -9.9999997E-05
 C    1.237300     -0.3726000       0.000000    
 C    1.711100       1.752000       1.252200    
 C    1.710400       1.752000      -1.252800    
 C   -1.308600      0.6384000       0.000000    
 C   -1.097800     -0.7445000     -6.0000003E-04
 C   0.2582000      -1.273900     -3.0000001E-04
 C   -2.609700       1.148800      6.0000003E-04
 C   -2.199000      -1.609400     -6.9999998E-04
 C   -3.701800      0.2820000      6.0000003E-04
 C   -3.496700      -1.095900       0.000000    
 H    1.504400       2.828500       1.289900    
 H    1.276800       1.324900       2.164100    
 H    2.797100       1.617100       1.290200    
 H    1.275600       1.324700      -2.164500    
 H    1.503600       2.828400      -1.290500    
 H    2.796400       1.617100      -1.291300    
 H   0.4184000      -2.346100     -3.0000001E-04
 H   -2.779600       2.222400      1.0000000E-03
 H   -2.059400      -2.687900     -1.1000000E-03
 H   -4.711900      0.6811000      1.1000000E-03
 H   -4.347200      -1.771400       0.000000    


%chk=000042463-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000042463

0 1
O -0.312200 1.551428 0.000688
O 3.218804 -1.108578 -1.141971
O 3.217520 -1.111305 1.142477
N 2.653221 -0.906248 0.000186
C 1.141199 1.145424 -0.000017
C 1.262989 -0.383163 0.000029
C 1.742909 1.767611 1.279553
C 1.741710 1.767507 -1.280216
C -1.365568 0.630416 0.000346
C -1.148542 -0.777119 -0.000094
C 0.228090 -1.260361 -0.000049
C -2.671766 1.162003 0.000545
C -2.271118 -1.643271 -0.000401
C -3.774959 0.280608 0.000244
C -3.581132 -1.123114 -0.000241
H 1.543559 2.852614 1.271664
H 1.286271 1.327002 2.180751
H 2.833716 1.606638 1.325456
H 1.284087 1.326931 -2.180930
H 1.542505 2.852540 -1.272152
H 2.832436 1.606349 -1.327244
H 0.413998 -2.340516 -0.000043
H -2.805403 2.247604 0.000932
H -2.105799 -2.727452 -0.000731
H -4.789720 0.693178 0.000390
H -4.442510 -1.798028 -0.000473


